USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 242 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 DT C7 :methyl -30:sc= -5.33! (180deg=-9.79!) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -1.49 (180deg=-1.29) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -28.8! (180deg=-36.3!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -5.78! (180deg=-7.05!) USER MOD Single : A 11 DT C7 :methyl 150:sc= -0.185 (180deg=-0.185) USER MOD Single : A 15 DT C7 :methyl -30:sc= -3.1! (180deg=-8.47!) USER MOD Single : A 16 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 17 DT C7 :methyl -30:sc= -2.87! (180deg=-5.59!) USER MOD Single : A 18 DT C7 :methyl 150:sc= -2.14 (180deg=-2.14) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -3.860 -6.901 -6.692 1.00 0.56 O ATOM 2 C5' DG A 1 -4.140 -6.475 -5.359 1.00 0.43 C ATOM 3 C4' DG A 1 -5.565 -5.938 -5.219 1.00 0.29 C ATOM 4 O4' DG A 1 -5.850 -5.705 -3.834 1.00 0.26 O ATOM 5 C3' DG A 1 -5.813 -4.632 -5.965 1.00 0.27 C ATOM 6 O3' DG A 1 -7.130 -4.638 -6.554 1.00 0.28 O ATOM 7 C2' DG A 1 -5.709 -3.562 -4.888 1.00 0.21 C ATOM 8 C1' DG A 1 -6.089 -4.309 -3.612 1.00 0.18 C ATOM 9 N9 DG A 1 -5.312 -3.929 -2.419 1.00 0.16 N ATOM 10 C8 DG A 1 -5.760 -3.724 -1.141 1.00 0.17 C ATOM 11 N7 DG A 1 -4.815 -3.462 -0.286 1.00 0.16 N ATOM 12 C5 DG A 1 -3.656 -3.493 -1.048 1.00 0.14 C ATOM 13 C6 DG A 1 -2.311 -3.285 -0.657 1.00 0.14 C ATOM 14 O6 DG A 1 -1.883 -3.019 0.457 1.00 0.18 O ATOM 15 N1 DG A 1 -1.439 -3.409 -1.719 1.00 0.14 N ATOM 16 C2 DG A 1 -1.822 -3.690 -3.019 1.00 0.13 C ATOM 17 N2 DG A 1 -0.859 -3.737 -3.937 1.00 0.15 N ATOM 18 N3 DG A 1 -3.088 -3.888 -3.389 1.00 0.14 N ATOM 19 C4 DG A 1 -3.948 -3.775 -2.356 1.00 0.13 C ATOM 0 H5' DG A 1 -3.430 -5.700 -5.069 1.00 0.43 H new ATOM 0 H5'' DG A 1 -3.998 -7.311 -4.674 1.00 0.43 H new ATOM 0 H4' DG A 1 -6.213 -6.697 -5.657 1.00 0.29 H new ATOM 0 H3' DG A 1 -5.108 -4.469 -6.780 1.00 0.27 H new ATOM 0 H2' DG A 1 -4.702 -3.149 -4.827 1.00 0.21 H new ATOM 0 H2'' DG A 1 -6.384 -2.729 -5.082 1.00 0.21 H new ATOM 0 HO5' DG A 1 -2.940 -7.236 -6.742 1.00 0.56 H new ATOM 0 H1' DG A 1 -7.131 -4.059 -3.412 1.00 0.18 H new ATOM 0 H8 DG A 1 -6.804 -3.775 -0.868 1.00 0.17 H new ATOM 0 H1 DG A 1 -0.444 -3.285 -1.533 1.00 0.14 H new ATOM 0 H21 DG A 1 -1.091 -3.940 -4.909 1.00 0.15 H new ATOM 0 H22 DG A 1 0.111 -3.570 -3.668 1.00 0.15 H new ATOM 32 P DG A 2 -8.479 -4.899 -5.696 1.00 0.24 P ATOM 33 OP1 DG A 2 -8.288 -6.095 -4.850 1.00 0.25 O ATOM 34 OP2 DG A 2 -9.629 -4.846 -6.629 1.00 0.31 O ATOM 35 O5' DG A 2 -8.560 -3.614 -4.738 1.00 0.22 O ATOM 36 C5' DG A 2 -9.452 -3.593 -3.621 1.00 0.23 C ATOM 37 C4' DG A 2 -9.290 -2.307 -2.825 1.00 0.20 C ATOM 38 O4' DG A 2 -7.973 -2.240 -2.291 1.00 0.19 O ATOM 39 C3' DG A 2 -9.501 -1.050 -3.662 1.00 0.22 C ATOM 40 O3' DG A 2 -10.763 -0.478 -3.313 1.00 0.27 O ATOM 41 C2' DG A 2 -8.352 -0.112 -3.271 1.00 0.19 C ATOM 42 C1' DG A 2 -7.606 -0.871 -2.182 1.00 0.16 C ATOM 43 N9 DG A 2 -6.151 -0.794 -2.297 1.00 0.16 N ATOM 44 C8 DG A 2 -5.381 -0.839 -3.421 1.00 0.16 C ATOM 45 N7 DG A 2 -4.120 -0.657 -3.195 1.00 0.16 N ATOM 46 C5 DG A 2 -4.044 -0.486 -1.833 1.00 0.15 C ATOM 47 C6 DG A 2 -2.920 -0.250 -1.027 1.00 0.15 C ATOM 48 O6 DG A 2 -1.756 -0.141 -1.367 1.00 0.17 O ATOM 49 N1 DG A 2 -3.263 -0.133 0.291 1.00 0.15 N ATOM 50 C2 DG A 2 -4.524 -0.228 0.800 1.00 0.15 C ATOM 51 N2 DG A 2 -4.643 -0.049 2.124 1.00 0.17 N ATOM 52 N3 DG A 2 -5.603 -0.457 0.045 1.00 0.15 N ATOM 53 C4 DG A 2 -5.281 -0.572 -1.264 1.00 0.15 C ATOM 0 H5' DG A 2 -9.257 -4.451 -2.978 1.00 0.23 H new ATOM 0 H5'' DG A 2 -10.481 -3.683 -3.970 1.00 0.23 H new ATOM 0 H4' DG A 2 -10.051 -2.336 -2.046 1.00 0.20 H new ATOM 0 H3' DG A 2 -9.505 -1.242 -4.735 1.00 0.22 H new ATOM 0 H2' DG A 2 -7.705 0.102 -4.122 1.00 0.19 H new ATOM 0 H2'' DG A 2 -8.725 0.845 -2.906 1.00 0.19 H new ATOM 0 H1' DG A 2 -7.877 -0.419 -1.228 1.00 0.16 H new ATOM 0 H8 DG A 2 -5.786 -1.010 -4.408 1.00 0.16 H new ATOM 0 H1 DG A 2 -2.507 0.041 0.953 1.00 0.15 H new ATOM 0 H21 DG A 2 -5.560 -0.108 2.566 1.00 0.17 H new ATOM 0 H22 DG A 2 -3.816 0.146 2.689 1.00 0.17 H new ATOM 65 P DG A 3 -11.180 0.998 -3.800 1.00 0.30 P ATOM 66 OP1 DG A 3 -12.657 1.082 -3.806 1.00 0.41 O ATOM 67 OP2 DG A 3 -10.417 1.328 -5.025 1.00 0.35 O ATOM 68 O5' DG A 3 -10.624 1.917 -2.608 1.00 0.25 O ATOM 69 C5' DG A 3 -10.903 1.582 -1.248 1.00 0.26 C ATOM 70 C4' DG A 3 -10.046 2.399 -0.293 1.00 0.21 C ATOM 71 O4' DG A 3 -8.656 2.107 -0.514 1.00 0.21 O ATOM 72 C3' DG A 3 -10.208 3.922 -0.458 1.00 0.20 C ATOM 73 O3' DG A 3 -10.171 4.565 0.828 1.00 0.22 O ATOM 74 C2' DG A 3 -8.952 4.299 -1.225 1.00 0.19 C ATOM 75 C1' DG A 3 -7.979 3.355 -0.552 1.00 0.18 C ATOM 76 N9 DG A 3 -6.683 3.165 -1.219 1.00 0.17 N ATOM 77 C8 DG A 3 -6.411 2.905 -2.529 1.00 0.18 C ATOM 78 N7 DG A 3 -5.136 2.796 -2.792 1.00 0.17 N ATOM 79 C5 DG A 3 -4.526 2.995 -1.556 1.00 0.15 C ATOM 80 C6 DG A 3 -3.150 2.993 -1.199 1.00 0.15 C ATOM 81 O6 DG A 3 -2.181 2.805 -1.925 1.00 0.18 O ATOM 82 N1 DG A 3 -2.981 3.233 0.162 1.00 0.13 N ATOM 83 C2 DG A 3 -3.991 3.446 1.052 1.00 0.14 C ATOM 84 N2 DG A 3 -3.627 3.626 2.319 1.00 0.17 N ATOM 85 N3 DG A 3 -5.279 3.452 0.721 1.00 0.15 N ATOM 86 C4 DG A 3 -5.470 3.220 -0.594 1.00 0.15 C ATOM 0 H5' DG A 3 -10.719 0.520 -1.087 1.00 0.26 H new ATOM 0 H5'' DG A 3 -11.958 1.759 -1.036 1.00 0.26 H new ATOM 0 H4' DG A 3 -10.381 2.120 0.706 1.00 0.21 H new ATOM 0 H3' DG A 3 -11.142 4.208 -0.942 1.00 0.20 H new ATOM 0 H2' DG A 3 -9.042 4.119 -2.296 1.00 0.19 H new ATOM 0 H2'' DG A 3 -8.679 5.347 -1.099 1.00 0.19 H new ATOM 0 H1' DG A 3 -7.715 3.782 0.416 1.00 0.18 H new ATOM 0 H8 DG A 3 -7.179 2.799 -3.281 1.00 0.18 H new ATOM 0 H1 DG A 3 -2.026 3.251 0.521 1.00 0.13 H new ATOM 0 H21 DG A 3 -4.335 3.790 3.035 1.00 0.17 H new ATOM 0 H22 DG A 3 -2.640 3.600 2.575 1.00 0.17 H new ATOM 98 P DT A 4 -11.113 4.098 2.051 1.00 0.29 P ATOM 99 OP1 DT A 4 -11.236 2.622 2.032 1.00 0.41 O ATOM 100 OP2 DT A 4 -12.331 4.938 2.042 1.00 0.40 O ATOM 101 O5' DT A 4 -10.228 4.506 3.339 1.00 0.34 O ATOM 102 C5' DT A 4 -10.407 5.770 3.994 1.00 0.44 C ATOM 103 C4' DT A 4 -9.112 6.584 4.038 1.00 0.35 C ATOM 104 O4' DT A 4 -8.206 6.028 5.004 1.00 0.33 O ATOM 105 C3' DT A 4 -8.378 6.647 2.696 1.00 0.31 C ATOM 106 O3' DT A 4 -8.324 8.009 2.249 1.00 0.38 O ATOM 107 C2' DT A 4 -6.963 6.136 2.993 1.00 0.29 C ATOM 108 C1' DT A 4 -7.120 5.391 4.323 1.00 0.29 C ATOM 109 N1 DT A 4 -7.427 3.943 4.164 1.00 0.27 N ATOM 110 C2 DT A 4 -8.447 3.382 4.934 1.00 0.34 C ATOM 111 O2 DT A 4 -8.954 3.953 5.895 1.00 0.42 O ATOM 112 N3 DT A 4 -8.833 2.103 4.588 1.00 0.35 N ATOM 113 C4 DT A 4 -8.313 1.344 3.565 1.00 0.31 C ATOM 114 O4 DT A 4 -8.742 0.214 3.345 1.00 0.37 O ATOM 115 C5 DT A 4 -7.260 1.995 2.825 1.00 0.24 C ATOM 116 C7 DT A 4 -6.754 1.351 1.546 1.00 0.22 C ATOM 117 C6 DT A 4 -6.832 3.233 3.153 1.00 0.23 C ATOM 0 H5' DT A 4 -10.765 5.604 5.010 1.00 0.44 H new ATOM 0 H5'' DT A 4 -11.176 6.341 3.475 1.00 0.44 H new ATOM 0 H4' DT A 4 -9.416 7.596 4.306 1.00 0.35 H new ATOM 0 H3' DT A 4 -8.869 6.059 1.921 1.00 0.31 H new ATOM 0 H2' DT A 4 -6.601 5.476 2.204 1.00 0.29 H new ATOM 0 H2'' DT A 4 -6.250 6.956 3.075 1.00 0.29 H new ATOM 0 H1' DT A 4 -6.177 5.436 4.868 1.00 0.29 H new ATOM 0 H3 DT A 4 -9.576 1.679 5.144 1.00 0.35 H new ATOM 0 H71 DT A 4 -6.860 0.269 1.617 1.00 0.22 H new ATOM 0 H72 DT A 4 -7.334 1.718 0.700 1.00 0.22 H new ATOM 0 H73 DT A 4 -5.703 1.604 1.402 1.00 0.22 H new ATOM 0 H6 DT A 4 -6.008 3.671 2.610 1.00 0.23 H new ATOM 130 P DT A 5 -8.470 8.363 0.680 1.00 0.32 P ATOM 131 OP1 DT A 5 -7.958 9.736 0.468 1.00 0.52 O ATOM 132 OP2 DT A 5 -9.842 8.012 0.251 1.00 0.50 O ATOM 133 O5' DT A 5 -7.446 7.319 -0.002 1.00 0.44 O ATOM 134 C5' DT A 5 -7.068 7.432 -1.383 1.00 0.34 C ATOM 135 C4' DT A 5 -5.609 7.856 -1.526 1.00 0.29 C ATOM 136 O4' DT A 5 -5.481 9.218 -1.116 1.00 0.40 O ATOM 137 C3' DT A 5 -4.648 7.009 -0.689 1.00 0.35 C ATOM 138 O3' DT A 5 -3.845 6.164 -1.538 1.00 0.43 O ATOM 139 C2' DT A 5 -3.752 8.008 0.043 1.00 0.38 C ATOM 140 C1' DT A 5 -4.400 9.372 -0.191 1.00 0.32 C ATOM 141 N1 DT A 5 -4.952 9.998 1.036 1.00 0.49 N ATOM 142 C2 DT A 5 -5.033 11.376 1.070 1.00 1.00 C ATOM 143 O2 DT A 5 -4.666 12.081 0.136 1.00 1.22 O ATOM 144 N3 DT A 5 -5.553 11.923 2.226 1.00 1.28 N ATOM 145 C4 DT A 5 -5.991 11.225 3.337 1.00 1.08 C ATOM 146 O4 DT A 5 -6.438 11.823 4.313 1.00 1.39 O ATOM 147 C5 DT A 5 -5.867 9.790 3.213 1.00 0.56 C ATOM 148 C7 DT A 5 -6.314 8.878 4.358 1.00 0.43 C ATOM 149 C6 DT A 5 -5.366 9.236 2.097 1.00 0.35 C ATOM 0 H5' DT A 5 -7.710 8.159 -1.880 1.00 0.34 H new ATOM 0 H5'' DT A 5 -7.222 6.476 -1.884 1.00 0.34 H new ATOM 0 H4' DT A 5 -5.340 7.718 -2.573 1.00 0.29 H new ATOM 0 H3' DT A 5 -5.188 6.358 -0.001 1.00 0.35 H new ATOM 0 H2' DT A 5 -3.692 7.778 1.107 1.00 0.38 H new ATOM 0 H2'' DT A 5 -2.734 7.983 -0.346 1.00 0.38 H new ATOM 0 H1' DT A 5 -3.609 10.022 -0.566 1.00 0.32 H new ATOM 0 H3 DT A 5 -5.621 12.940 2.265 1.00 1.28 H new ATOM 0 H71 DT A 5 -6.188 9.398 5.308 1.00 0.43 H new ATOM 0 H72 DT A 5 -7.363 8.615 4.225 1.00 0.43 H new ATOM 0 H73 DT A 5 -5.709 7.971 4.358 1.00 0.43 H new ATOM 0 H6 DT A 5 -5.287 8.161 2.034 1.00 0.35 H new ATOM 162 P DT A 6 -3.061 6.729 -2.833 1.00 0.28 P ATOM 163 OP1 DT A 6 -2.382 7.997 -2.479 1.00 0.29 O ATOM 164 OP2 DT A 6 -3.993 6.700 -3.978 1.00 0.40 O ATOM 165 O5' DT A 6 -1.935 5.597 -3.100 1.00 0.28 O ATOM 166 C5' DT A 6 -0.917 5.281 -2.138 1.00 0.28 C ATOM 167 C4' DT A 6 -0.391 6.522 -1.427 1.00 0.21 C ATOM 168 O4' DT A 6 -1.006 6.646 -0.154 1.00 0.19 O ATOM 169 C3' DT A 6 1.113 6.519 -1.166 1.00 0.26 C ATOM 170 O3' DT A 6 1.782 7.318 -2.147 1.00 0.33 O ATOM 171 C2' DT A 6 1.266 7.147 0.224 1.00 0.25 C ATOM 172 C1' DT A 6 -0.165 7.495 0.619 1.00 0.19 C ATOM 173 N1 DT A 6 -0.484 7.285 2.051 1.00 0.20 N ATOM 174 C2 DT A 6 0.504 7.546 2.988 1.00 0.25 C ATOM 175 O2 DT A 6 1.629 7.933 2.678 1.00 0.32 O ATOM 176 N3 DT A 6 0.141 7.388 4.305 1.00 0.26 N ATOM 177 C4 DT A 6 -1.100 7.017 4.771 1.00 0.25 C ATOM 178 O4 DT A 6 -1.318 6.943 5.977 1.00 0.30 O ATOM 179 C5 DT A 6 -2.065 6.764 3.733 1.00 0.23 C ATOM 180 C7 DT A 6 -3.483 6.353 4.113 1.00 0.28 C ATOM 181 C6 DT A 6 -1.736 6.894 2.434 1.00 0.20 C ATOM 0 H5' DT A 6 -0.092 4.774 -2.638 1.00 0.28 H new ATOM 0 H5'' DT A 6 -1.319 4.585 -1.401 1.00 0.28 H new ATOM 0 H4' DT A 6 -0.624 7.343 -2.105 1.00 0.21 H new ATOM 0 H3' DT A 6 1.544 5.519 -1.218 1.00 0.26 H new ATOM 0 H2' DT A 6 1.719 6.452 0.931 1.00 0.25 H new ATOM 0 H2'' DT A 6 1.901 8.032 0.196 1.00 0.25 H new ATOM 0 H1' DT A 6 -0.311 8.560 0.438 1.00 0.19 H new ATOM 0 H3 DT A 6 0.862 7.563 5.005 1.00 0.26 H new ATOM 0 H71 DT A 6 -4.180 6.705 3.352 1.00 0.28 H new ATOM 0 H72 DT A 6 -3.540 5.267 4.183 1.00 0.28 H new ATOM 0 H73 DT A 6 -3.744 6.793 5.075 1.00 0.28 H new ATOM 0 H6 DT A 6 -2.478 6.685 1.678 1.00 0.20 H new ATOM 194 P DT A 7 3.319 7.770 -1.933 1.00 0.31 P ATOM 195 OP1 DT A 7 3.993 6.771 -1.077 1.00 0.31 O ATOM 196 OP2 DT A 7 3.327 9.198 -1.542 1.00 0.38 O ATOM 197 O5' DT A 7 3.925 7.667 -3.414 1.00 0.31 O ATOM 198 C5' DT A 7 4.400 6.425 -3.943 1.00 0.28 C ATOM 199 C4' DT A 7 4.524 6.510 -5.464 1.00 0.32 C ATOM 200 O4' DT A 7 3.219 6.481 -6.048 1.00 0.38 O ATOM 201 C3' DT A 7 5.244 7.767 -5.957 1.00 0.35 C ATOM 202 O3' DT A 7 6.289 7.382 -6.852 1.00 0.39 O ATOM 203 C2' DT A 7 4.193 8.583 -6.721 1.00 0.41 C ATOM 204 C1' DT A 7 2.959 7.682 -6.784 1.00 0.41 C ATOM 205 N1 DT A 7 1.730 8.292 -6.217 1.00 0.43 N ATOM 206 C2 DT A 7 0.613 8.355 -7.032 1.00 0.52 C ATOM 207 O2 DT A 7 0.624 7.962 -8.195 1.00 0.61 O ATOM 208 N3 DT A 7 -0.524 8.894 -6.462 1.00 0.53 N ATOM 209 C4 DT A 7 -0.645 9.365 -5.168 1.00 0.47 C ATOM 210 O4 DT A 7 -1.709 9.837 -4.772 1.00 0.50 O ATOM 211 C5 DT A 7 0.568 9.259 -4.386 1.00 0.39 C ATOM 212 C7 DT A 7 0.569 9.688 -2.918 1.00 0.35 C ATOM 213 C6 DT A 7 1.693 8.746 -4.921 1.00 0.37 C ATOM 0 H5' DT A 7 3.716 5.621 -3.671 1.00 0.28 H new ATOM 0 H5'' DT A 7 5.368 6.182 -3.505 1.00 0.28 H new ATOM 0 H4' DT A 7 5.125 5.653 -5.768 1.00 0.32 H new ATOM 0 H3' DT A 7 5.678 8.339 -5.137 1.00 0.35 H new ATOM 0 H2' DT A 7 3.972 9.519 -6.209 1.00 0.41 H new ATOM 0 H2'' DT A 7 4.544 8.841 -7.720 1.00 0.41 H new ATOM 0 H1' DT A 7 2.777 7.499 -7.843 1.00 0.41 H new ATOM 0 H3 DT A 7 -1.354 8.950 -7.053 1.00 0.53 H new ATOM 0 H71 DT A 7 -0.159 10.485 -2.771 1.00 0.35 H new ATOM 0 H72 DT A 7 0.306 8.837 -2.290 1.00 0.35 H new ATOM 0 H73 DT A 7 1.561 10.048 -2.645 1.00 0.35 H new ATOM 0 H6 DT A 7 2.587 8.690 -4.317 1.00 0.37 H new ATOM 226 P DG A 8 7.818 7.790 -6.548 1.00 0.44 P ATOM 227 OP1 DG A 8 7.831 9.143 -5.945 1.00 0.51 O ATOM 228 OP2 DG A 8 8.613 7.519 -7.763 1.00 0.56 O ATOM 229 O5' DG A 8 8.257 6.728 -5.410 1.00 0.39 O ATOM 230 C5' DG A 8 8.368 5.323 -5.699 1.00 0.35 C ATOM 231 C4' DG A 8 8.782 4.525 -4.456 1.00 0.29 C ATOM 232 O4' DG A 8 7.910 4.868 -3.364 1.00 0.27 O ATOM 233 C3' DG A 8 8.710 2.988 -4.620 1.00 0.28 C ATOM 234 O3' DG A 8 9.856 2.373 -3.980 1.00 0.26 O ATOM 235 C2' DG A 8 7.435 2.635 -3.872 1.00 0.27 C ATOM 236 C1' DG A 8 7.491 3.656 -2.755 1.00 0.21 C ATOM 237 N9 DG A 8 6.231 3.876 -2.045 1.00 0.18 N ATOM 238 C8 DG A 8 6.053 4.152 -0.721 1.00 0.17 C ATOM 239 N7 DG A 8 4.809 4.160 -0.344 1.00 0.15 N ATOM 240 C5 DG A 8 4.115 3.876 -1.514 1.00 0.15 C ATOM 241 C6 DG A 8 2.728 3.750 -1.735 1.00 0.15 C ATOM 242 O6 DG A 8 1.819 3.836 -0.922 1.00 0.17 O ATOM 243 N1 DG A 8 2.452 3.469 -3.054 1.00 0.16 N ATOM 244 C2 DG A 8 3.384 3.319 -4.046 1.00 0.18 C ATOM 245 N2 DG A 8 2.924 3.065 -5.263 1.00 0.19 N ATOM 246 N3 DG A 8 4.685 3.430 -3.845 1.00 0.19 N ATOM 247 C4 DG A 8 4.979 3.709 -2.558 1.00 0.17 C ATOM 0 H5' DG A 8 9.101 5.170 -6.492 1.00 0.35 H new ATOM 0 H5'' DG A 8 7.414 4.950 -6.071 1.00 0.35 H new ATOM 0 H4' DG A 8 9.824 4.790 -4.278 1.00 0.29 H new ATOM 0 H3' DG A 8 8.712 2.652 -5.657 1.00 0.28 H new ATOM 0 H2' DG A 8 6.545 2.744 -4.492 1.00 0.27 H new ATOM 0 H2'' DG A 8 7.441 1.610 -3.500 1.00 0.27 H new ATOM 0 H1' DG A 8 8.170 3.284 -1.988 1.00 0.21 H new ATOM 0 H8 DG A 8 6.873 4.347 -0.046 1.00 0.17 H new ATOM 0 H1 DG A 8 1.471 3.364 -3.314 1.00 0.16 H new ATOM 0 H21 DG A 8 3.575 2.944 -6.039 1.00 0.19 H new ATOM 0 H22 DG A 8 1.919 2.990 -5.423 1.00 0.19 H new ATOM 259 P DG A 9 9.841 0.828 -3.474 1.00 0.24 P ATOM 260 OP1 DG A 9 11.243 0.362 -3.380 1.00 0.26 O ATOM 261 OP2 DG A 9 8.868 0.070 -4.291 1.00 0.29 O ATOM 262 O5' DG A 9 9.249 0.967 -1.980 1.00 0.23 O ATOM 263 C5' DG A 9 9.863 1.873 -1.053 1.00 0.19 C ATOM 264 C4' DG A 9 9.220 1.830 0.333 1.00 0.15 C ATOM 265 O4' DG A 9 7.805 2.128 0.309 1.00 0.16 O ATOM 266 C3' DG A 9 9.348 0.468 1.021 1.00 0.15 C ATOM 267 O3' DG A 9 10.289 0.568 2.093 1.00 0.16 O ATOM 268 C2' DG A 9 7.951 0.206 1.577 1.00 0.15 C ATOM 269 C1' DG A 9 7.336 1.581 1.536 1.00 0.13 C ATOM 270 N9 DG A 9 5.853 1.571 1.640 1.00 0.13 N ATOM 271 C8 DG A 9 5.112 1.713 2.789 1.00 0.13 C ATOM 272 N7 DG A 9 3.832 1.552 2.628 1.00 0.12 N ATOM 273 C5 DG A 9 3.699 1.287 1.269 1.00 0.11 C ATOM 274 C6 DG A 9 2.526 1.027 0.517 1.00 0.11 C ATOM 275 O6 DG A 9 1.368 0.984 0.924 1.00 0.14 O ATOM 276 N1 DG A 9 2.810 0.808 -0.826 1.00 0.11 N ATOM 277 C2 DG A 9 4.080 0.835 -1.375 1.00 0.12 C ATOM 278 N2 DG A 9 4.167 0.611 -2.687 1.00 0.14 N ATOM 279 N3 DG A 9 5.190 1.079 -0.666 1.00 0.12 N ATOM 280 C4 DG A 9 4.929 1.297 0.647 1.00 0.11 C ATOM 0 H5' DG A 9 9.799 2.887 -1.447 1.00 0.19 H new ATOM 0 H5'' DG A 9 10.922 1.632 -0.964 1.00 0.19 H new ATOM 0 H4' DG A 9 9.771 2.592 0.884 1.00 0.15 H new ATOM 0 H3' DG A 9 9.690 -0.323 0.354 1.00 0.15 H new ATOM 0 H2' DG A 9 7.396 -0.508 0.968 1.00 0.15 H new ATOM 0 H2'' DG A 9 7.983 -0.197 2.589 1.00 0.15 H new ATOM 0 H1' DG A 9 7.628 2.183 2.397 1.00 0.13 H new ATOM 0 H8 DG A 9 5.557 1.940 3.747 1.00 0.13 H new ATOM 0 H1 DG A 9 2.027 0.614 -1.451 1.00 0.11 H new ATOM 0 H21 DG A 9 5.078 0.619 -3.146 1.00 0.14 H new ATOM 0 H22 DG A 9 3.323 0.432 -3.231 1.00 0.14 H new ATOM 292 P DG A 10 10.704 -0.731 2.948 1.00 0.20 P ATOM 293 OP1 DG A 10 11.928 -0.406 3.709 1.00 0.26 O ATOM 294 OP2 DG A 10 10.692 -1.905 2.049 1.00 0.26 O ATOM 295 O5' DG A 10 9.485 -0.882 3.983 1.00 0.18 O ATOM 296 C5' DG A 10 9.235 0.127 4.964 1.00 0.21 C ATOM 297 C4' DG A 10 7.898 -0.098 5.657 1.00 0.18 C ATOM 298 O4' DG A 10 6.876 -0.227 4.666 1.00 0.17 O ATOM 299 C3' DG A 10 7.849 -1.358 6.537 1.00 0.20 C ATOM 300 O3' DG A 10 7.275 -1.033 7.811 1.00 0.24 O ATOM 301 C2' DG A 10 6.917 -2.302 5.784 1.00 0.20 C ATOM 302 C1' DG A 10 6.040 -1.317 5.025 1.00 0.17 C ATOM 303 N9 DG A 10 5.403 -1.818 3.789 1.00 0.15 N ATOM 304 C8 DG A 10 5.944 -2.060 2.548 1.00 0.16 C ATOM 305 N7 DG A 10 5.062 -2.376 1.636 1.00 0.15 N ATOM 306 C5 DG A 10 3.854 -2.345 2.330 1.00 0.14 C ATOM 307 C6 DG A 10 2.530 -2.599 1.882 1.00 0.15 C ATOM 308 O6 DG A 10 2.145 -2.907 0.768 1.00 0.18 O ATOM 309 N1 DG A 10 1.617 -2.462 2.901 1.00 0.14 N ATOM 310 C2 DG A 10 1.923 -2.125 4.191 1.00 0.14 C ATOM 311 N2 DG A 10 0.912 -2.063 5.040 1.00 0.16 N ATOM 312 N3 DG A 10 3.151 -1.883 4.620 1.00 0.15 N ATOM 313 C4 DG A 10 4.063 -2.010 3.640 1.00 0.14 C ATOM 0 H5' DG A 10 9.241 1.108 4.490 1.00 0.21 H new ATOM 0 H5'' DG A 10 10.036 0.125 5.704 1.00 0.21 H new ATOM 0 H4' DG A 10 7.750 0.763 6.308 1.00 0.18 H new ATOM 0 H3' DG A 10 8.835 -1.788 6.716 1.00 0.20 H new ATOM 0 H2' DG A 10 7.461 -2.968 5.114 1.00 0.20 H new ATOM 0 H2'' DG A 10 6.338 -2.932 6.459 1.00 0.20 H new ATOM 0 H1' DG A 10 5.213 -1.071 5.690 1.00 0.17 H new ATOM 0 H8 DG A 10 7.003 -1.995 2.345 1.00 0.16 H new ATOM 0 H1 DG A 10 0.635 -2.624 2.678 1.00 0.14 H new ATOM 0 H21 DG A 10 1.080 -1.817 6.015 1.00 0.16 H new ATOM 0 H22 DG A 10 -0.036 -2.262 4.720 1.00 0.16 H new ATOM 325 P DT A 11 7.918 0.114 8.749 1.00 0.28 P ATOM 326 OP1 DT A 11 9.385 -0.080 8.785 1.00 0.37 O ATOM 327 OP2 DT A 11 7.145 0.166 10.009 1.00 0.41 O ATOM 328 O5' DT A 11 7.612 1.455 7.907 1.00 0.27 O ATOM 329 C5' DT A 11 7.072 2.623 8.538 1.00 0.36 C ATOM 330 C4' DT A 11 7.620 3.903 7.908 1.00 0.31 C ATOM 331 O4' DT A 11 9.018 4.039 8.226 1.00 0.35 O ATOM 332 C3' DT A 11 7.498 3.939 6.379 1.00 0.26 C ATOM 333 O3' DT A 11 7.121 5.252 5.953 1.00 0.28 O ATOM 334 C2' DT A 11 8.908 3.636 5.898 1.00 0.33 C ATOM 335 C1' DT A 11 9.746 4.261 7.014 1.00 0.35 C ATOM 336 N1 DT A 11 11.087 3.659 7.172 1.00 0.48 N ATOM 337 C2 DT A 11 12.176 4.408 6.763 1.00 0.61 C ATOM 338 O2 DT A 11 12.058 5.534 6.287 1.00 0.61 O ATOM 339 N3 DT A 11 13.414 3.814 6.916 1.00 0.76 N ATOM 340 C4 DT A 11 13.655 2.556 7.435 1.00 0.82 C ATOM 341 O4 DT A 11 14.802 2.130 7.526 1.00 1.00 O ATOM 342 C5 DT A 11 12.459 1.845 7.836 1.00 0.69 C ATOM 343 C7 DT A 11 12.579 0.441 8.424 1.00 0.81 C ATOM 344 C6 DT A 11 11.240 2.403 7.698 1.00 0.54 C ATOM 0 H5' DT A 11 7.312 2.608 9.601 1.00 0.36 H new ATOM 0 H5'' DT A 11 5.985 2.612 8.457 1.00 0.36 H new ATOM 0 H4' DT A 11 7.019 4.715 8.318 1.00 0.31 H new ATOM 0 H3' DT A 11 6.753 3.242 5.996 1.00 0.26 H new ATOM 0 H2' DT A 11 9.088 2.565 5.799 1.00 0.33 H new ATOM 0 H2'' DT A 11 9.116 4.085 4.927 1.00 0.33 H new ATOM 0 H1' DT A 11 9.908 5.311 6.772 1.00 0.35 H new ATOM 0 H3 DT A 11 14.226 4.355 6.618 1.00 0.76 H new ATOM 0 H71 DT A 11 11.762 0.269 9.124 1.00 0.81 H new ATOM 0 H72 DT A 11 12.530 -0.295 7.621 1.00 0.81 H new ATOM 0 H73 DT A 11 13.531 0.345 8.947 1.00 0.81 H new ATOM 0 H6 DT A 11 10.366 1.849 8.008 1.00 0.54 H new ATOM 357 P DG A 12 5.671 5.531 5.315 1.00 0.27 P ATOM 358 OP1 DG A 12 5.201 4.284 4.668 1.00 0.59 O ATOM 359 OP2 DG A 12 5.752 6.776 4.524 1.00 0.49 O ATOM 360 O5' DG A 12 4.765 5.830 6.617 1.00 0.30 O ATOM 361 C5' DG A 12 3.441 6.382 6.502 1.00 0.21 C ATOM 362 C4' DG A 12 2.533 5.839 7.591 1.00 0.17 C ATOM 363 O4' DG A 12 1.234 5.703 7.073 1.00 0.17 O ATOM 364 C3' DG A 12 2.960 4.472 8.094 1.00 0.18 C ATOM 365 O3' DG A 12 2.491 4.286 9.436 1.00 0.22 O ATOM 366 C2' DG A 12 2.240 3.552 7.132 1.00 0.17 C ATOM 367 C1' DG A 12 0.955 4.332 6.911 1.00 0.15 C ATOM 368 N9 DG A 12 0.353 4.226 5.602 1.00 0.14 N ATOM 369 C8 DG A 12 -0.950 4.173 5.355 1.00 0.15 C ATOM 370 N7 DG A 12 -1.262 4.081 4.088 1.00 0.16 N ATOM 371 C5 DG A 12 -0.018 4.098 3.456 1.00 0.13 C ATOM 372 C6 DG A 12 0.316 4.040 2.077 1.00 0.14 C ATOM 373 O6 DG A 12 -0.426 3.922 1.117 1.00 0.17 O ATOM 374 N1 DG A 12 1.681 4.104 1.885 1.00 0.13 N ATOM 375 C2 DG A 12 2.613 4.201 2.887 1.00 0.14 C ATOM 376 N2 DG A 12 3.875 4.275 2.513 1.00 0.17 N ATOM 377 N3 DG A 12 2.306 4.246 4.178 1.00 0.13 N ATOM 378 C4 DG A 12 0.979 4.191 4.387 1.00 0.12 C ATOM 0 H5' DG A 12 3.026 6.142 5.523 1.00 0.21 H new ATOM 0 H5'' DG A 12 3.488 7.469 6.570 1.00 0.21 H new ATOM 0 H4' DG A 12 2.583 6.543 8.422 1.00 0.17 H new ATOM 0 H3' DG A 12 4.037 4.310 8.125 1.00 0.18 H new ATOM 0 H2' DG A 12 2.797 3.401 6.207 1.00 0.17 H new ATOM 0 H2'' DG A 12 2.058 2.566 7.559 1.00 0.17 H new ATOM 0 H1' DG A 12 0.257 3.902 7.629 1.00 0.15 H new ATOM 0 H8 DG A 12 -1.693 4.203 6.138 1.00 0.15 H new ATOM 0 H1 DG A 12 2.023 4.077 0.925 1.00 0.13 H new ATOM 0 H21 DG A 12 4.611 4.349 3.215 1.00 0.17 H new ATOM 0 H22 DG A 12 4.115 4.259 1.522 1.00 0.17 H new ATOM 390 P DG A 13 2.603 2.856 10.163 1.00 0.25 P ATOM 391 OP1 DG A 13 2.710 3.084 11.622 1.00 0.32 O ATOM 392 OP2 DG A 13 3.631 2.050 9.463 1.00 0.29 O ATOM 393 O5' DG A 13 1.154 2.212 9.853 1.00 0.25 O ATOM 394 C5' DG A 13 -0.039 2.879 10.288 1.00 0.23 C ATOM 395 C4' DG A 13 -1.309 2.118 9.901 1.00 0.19 C ATOM 396 O4' DG A 13 -1.604 2.286 8.510 1.00 0.19 O ATOM 397 C3' DG A 13 -1.241 0.604 10.147 1.00 0.17 C ATOM 398 O3' DG A 13 -2.087 0.256 11.253 1.00 0.21 O ATOM 399 C2' DG A 13 -1.798 -0.010 8.857 1.00 0.16 C ATOM 400 C1' DG A 13 -2.430 1.186 8.168 1.00 0.15 C ATOM 401 N9 DG A 13 -2.535 1.079 6.692 1.00 0.14 N ATOM 402 C8 DG A 13 -3.677 0.923 5.939 1.00 0.14 C ATOM 403 N7 DG A 13 -3.473 0.872 4.665 1.00 0.15 N ATOM 404 C5 DG A 13 -2.105 1.008 4.546 1.00 0.13 C ATOM 405 C6 DG A 13 -1.330 1.034 3.386 1.00 0.14 C ATOM 406 O6 DG A 13 -1.697 1.007 2.241 1.00 0.19 O ATOM 407 N1 DG A 13 -0.013 1.176 3.644 1.00 0.12 N ATOM 408 C2 DG A 13 0.550 1.295 4.899 1.00 0.11 C ATOM 409 N2 DG A 13 1.873 1.462 4.944 1.00 0.12 N ATOM 410 N3 DG A 13 -0.175 1.279 6.032 1.00 0.12 N ATOM 411 C4 DG A 13 -1.506 1.130 5.773 1.00 0.13 C ATOM 0 H5' DG A 13 -0.072 3.878 9.854 1.00 0.23 H new ATOM 0 H5'' DG A 13 -0.009 3.002 11.371 1.00 0.23 H new ATOM 0 H4' DG A 13 -2.078 2.546 10.544 1.00 0.19 H new ATOM 0 H3' DG A 13 -0.234 0.257 10.380 1.00 0.17 H new ATOM 0 H2' DG A 13 -1.012 -0.459 8.250 1.00 0.16 H new ATOM 0 H2'' DG A 13 -2.529 -0.792 9.063 1.00 0.16 H new ATOM 0 H1' DG A 13 -3.463 1.279 8.502 1.00 0.15 H new ATOM 0 H8 DG A 13 -4.661 0.849 6.377 1.00 0.14 H new ATOM 0 H1 DG A 13 0.620 1.197 2.844 1.00 0.12 H new ATOM 0 H21 DG A 13 2.345 1.556 5.843 1.00 0.12 H new ATOM 0 H22 DG A 13 2.412 1.496 4.079 1.00 0.12 H new ATOM 423 P DG A 14 -2.011 -1.208 11.921 1.00 0.21 P ATOM 424 OP1 DG A 14 -2.653 -1.142 13.253 1.00 0.29 O ATOM 425 OP2 DG A 14 -0.620 -1.700 11.797 1.00 0.26 O ATOM 426 O5' DG A 14 -2.947 -2.091 10.950 1.00 0.21 O ATOM 427 C5' DG A 14 -4.371 -2.104 11.115 1.00 0.22 C ATOM 428 C4' DG A 14 -5.057 -2.805 9.948 1.00 0.22 C ATOM 429 O4' DG A 14 -4.791 -2.086 8.749 1.00 0.22 O ATOM 430 C3' DG A 14 -4.568 -4.231 9.717 1.00 0.22 C ATOM 431 O3' DG A 14 -5.444 -5.163 10.359 1.00 0.27 O ATOM 432 C2' DG A 14 -4.643 -4.423 8.202 1.00 0.23 C ATOM 433 C1' DG A 14 -4.800 -2.998 7.648 1.00 0.21 C ATOM 434 N9 DG A 14 -3.695 -2.636 6.762 1.00 0.18 N ATOM 435 C8 DG A 14 -2.410 -2.335 7.095 1.00 0.17 C ATOM 436 N7 DG A 14 -1.641 -2.107 6.083 1.00 0.15 N ATOM 437 C5 DG A 14 -2.473 -2.277 4.991 1.00 0.14 C ATOM 438 C6 DG A 14 -2.187 -2.168 3.617 1.00 0.14 C ATOM 439 O6 DG A 14 -1.134 -1.867 3.084 1.00 0.16 O ATOM 440 N1 DG A 14 -3.294 -2.433 2.846 1.00 0.15 N ATOM 441 C2 DG A 14 -4.540 -2.754 3.337 1.00 0.16 C ATOM 442 N2 DG A 14 -5.489 -2.984 2.441 1.00 0.17 N ATOM 443 N3 DG A 14 -4.819 -2.849 4.633 1.00 0.18 N ATOM 444 C4 DG A 14 -3.737 -2.601 5.398 1.00 0.16 C ATOM 0 H5' DG A 14 -4.739 -1.081 11.195 1.00 0.22 H new ATOM 0 H5'' DG A 14 -4.627 -2.609 12.047 1.00 0.22 H new ATOM 0 H4' DG A 14 -6.117 -2.838 10.201 1.00 0.22 H new ATOM 0 H3' DG A 14 -3.566 -4.392 10.116 1.00 0.22 H new ATOM 0 H2' DG A 14 -3.744 -4.903 7.817 1.00 0.23 H new ATOM 0 H2'' DG A 14 -5.486 -5.054 7.922 1.00 0.23 H new ATOM 0 H1' DG A 14 -5.731 -2.953 7.083 1.00 0.21 H new ATOM 0 H8 DG A 14 -2.064 -2.291 8.117 1.00 0.17 H new ATOM 0 H1 DG A 14 -3.184 -2.388 1.833 1.00 0.15 H new ATOM 0 H21 DG A 14 -6.431 -3.226 2.747 1.00 0.17 H new ATOM 0 H22 DG A 14 -5.277 -2.919 1.445 1.00 0.17 H new ATOM 456 P DT A 15 -5.132 -6.744 10.286 1.00 0.32 P ATOM 457 OP1 DT A 15 -6.108 -7.454 11.139 1.00 0.43 O ATOM 458 OP2 DT A 15 -3.680 -6.941 10.502 1.00 0.33 O ATOM 459 O5' DT A 15 -5.470 -7.091 8.748 1.00 0.32 O ATOM 460 C5' DT A 15 -4.671 -8.014 8.002 1.00 0.32 C ATOM 461 C4' DT A 15 -4.953 -7.910 6.502 1.00 0.29 C ATOM 462 O4' DT A 15 -4.459 -6.677 5.992 1.00 0.26 O ATOM 463 C3' DT A 15 -4.262 -8.971 5.661 1.00 0.28 C ATOM 464 O3' DT A 15 -5.091 -10.130 5.515 1.00 0.33 O ATOM 465 C2' DT A 15 -4.110 -8.300 4.295 1.00 0.26 C ATOM 466 C1' DT A 15 -4.374 -6.835 4.576 1.00 0.25 C ATOM 467 N1 DT A 15 -3.311 -5.984 4.035 1.00 0.23 N ATOM 468 C2 DT A 15 -3.494 -5.465 2.771 1.00 0.24 C ATOM 469 O2 DT A 15 -4.563 -5.550 2.176 1.00 0.30 O ATOM 470 N3 DT A 15 -2.414 -4.818 2.221 1.00 0.24 N ATOM 471 C4 DT A 15 -1.190 -4.631 2.812 1.00 0.21 C ATOM 472 O4 DT A 15 -0.283 -4.061 2.210 1.00 0.23 O ATOM 473 C5 DT A 15 -1.097 -5.179 4.139 1.00 0.20 C ATOM 474 C7 DT A 15 0.172 -4.950 4.935 1.00 0.19 C ATOM 475 C6 DT A 15 -2.134 -5.833 4.698 1.00 0.21 C ATOM 0 H5' DT A 15 -4.872 -9.030 8.342 1.00 0.32 H new ATOM 0 H5'' DT A 15 -3.615 -7.818 8.190 1.00 0.32 H new ATOM 0 H4' DT A 15 -6.035 -8.020 6.427 1.00 0.29 H new ATOM 0 H3' DT A 15 -3.323 -9.300 6.105 1.00 0.28 H new ATOM 0 H2' DT A 15 -3.113 -8.454 3.883 1.00 0.26 H new ATOM 0 H2'' DT A 15 -4.819 -8.702 3.572 1.00 0.26 H new ATOM 0 H1' DT A 15 -5.302 -6.531 4.093 1.00 0.25 H new ATOM 0 H3 DT A 15 -2.534 -4.440 1.281 1.00 0.24 H new ATOM 0 H71 DT A 15 1.019 -4.867 4.254 1.00 0.19 H new ATOM 0 H72 DT A 15 0.079 -4.030 5.511 1.00 0.19 H new ATOM 0 H73 DT A 15 0.332 -5.788 5.613 1.00 0.19 H new ATOM 0 H6 DT A 15 -2.028 -6.245 5.691 1.00 0.21 H new ATOM 488 P DT A 16 -4.522 -11.490 4.839 1.00 0.34 P ATOM 489 OP1 DT A 16 -5.635 -12.131 4.104 1.00 0.40 O ATOM 490 OP2 DT A 16 -3.804 -12.254 5.885 1.00 0.42 O ATOM 491 O5' DT A 16 -3.433 -10.974 3.747 1.00 0.28 O ATOM 492 C5' DT A 16 -3.788 -10.724 2.367 1.00 0.25 C ATOM 493 C4' DT A 16 -2.571 -10.262 1.542 1.00 0.25 C ATOM 494 O4' DT A 16 -1.804 -9.313 2.291 1.00 0.28 O ATOM 495 C3' DT A 16 -1.624 -11.391 1.112 1.00 0.27 C ATOM 496 O3' DT A 16 -1.319 -11.238 -0.283 1.00 0.29 O ATOM 497 C2' DT A 16 -0.338 -11.149 1.931 1.00 0.30 C ATOM 498 C1' DT A 16 -0.416 -9.654 2.225 1.00 0.28 C ATOM 499 N1 DT A 16 0.186 -9.246 3.510 1.00 0.27 N ATOM 500 C2 DT A 16 1.174 -8.277 3.480 1.00 0.31 C ATOM 501 O2 DT A 16 1.570 -7.771 2.433 1.00 0.37 O ATOM 502 N3 DT A 16 1.684 -7.894 4.703 1.00 0.31 N ATOM 503 C4 DT A 16 1.299 -8.385 5.938 1.00 0.28 C ATOM 504 O4 DT A 16 1.804 -7.953 6.968 1.00 0.32 O ATOM 505 C5 DT A 16 0.267 -9.393 5.874 1.00 0.26 C ATOM 506 C7 DT A 16 -0.249 -10.027 7.165 1.00 0.31 C ATOM 507 C6 DT A 16 -0.249 -9.784 4.693 1.00 0.25 C ATOM 0 H5' DT A 16 -4.568 -9.963 2.323 1.00 0.25 H new ATOM 0 H5'' DT A 16 -4.203 -11.631 1.928 1.00 0.25 H new ATOM 0 H4' DT A 16 -2.994 -9.828 0.636 1.00 0.25 H new ATOM 0 H3' DT A 16 -2.049 -12.382 1.271 1.00 0.27 H new ATOM 0 H2' DT A 16 -0.320 -11.743 2.845 1.00 0.30 H new ATOM 0 H2'' DT A 16 0.558 -11.406 1.366 1.00 0.30 H new ATOM 0 H1' DT A 16 0.141 -9.147 1.437 1.00 0.28 H new ATOM 0 H3 DT A 16 2.414 -7.182 4.696 1.00 0.31 H new ATOM 0 H71 DT A 16 -1.292 -10.317 7.036 1.00 0.31 H new ATOM 0 H72 DT A 16 0.347 -10.909 7.401 1.00 0.31 H new ATOM 0 H73 DT A 16 -0.170 -9.308 7.980 1.00 0.31 H new ATOM 0 H6 DT A 16 -1.022 -10.538 4.678 1.00 0.25 H new ATOM 520 P DT A 17 -2.454 -11.441 -1.412 1.00 0.29 P ATOM 521 OP1 DT A 17 -3.710 -10.847 -0.916 1.00 0.37 O ATOM 522 OP2 DT A 17 -2.427 -12.858 -1.849 1.00 0.40 O ATOM 523 O5' DT A 17 -1.916 -10.518 -2.618 1.00 0.26 O ATOM 524 C5' DT A 17 -1.823 -11.020 -3.957 1.00 0.26 C ATOM 525 C4' DT A 17 -1.099 -10.036 -4.867 1.00 0.25 C ATOM 526 O4' DT A 17 -1.908 -8.855 -5.064 1.00 0.25 O ATOM 527 C3' DT A 17 0.237 -9.574 -4.300 1.00 0.22 C ATOM 528 O3' DT A 17 1.314 -10.281 -4.923 1.00 0.25 O ATOM 529 C2' DT A 17 0.283 -8.103 -4.667 1.00 0.21 C ATOM 530 C1' DT A 17 -1.185 -7.717 -4.577 1.00 0.22 C ATOM 531 N1 DT A 17 -1.667 -7.424 -3.208 1.00 0.20 N ATOM 532 C2 DT A 17 -0.901 -6.585 -2.414 1.00 0.22 C ATOM 533 O2 DT A 17 0.122 -6.036 -2.813 1.00 0.26 O ATOM 534 N3 DT A 17 -1.382 -6.350 -1.148 1.00 0.24 N ATOM 535 C4 DT A 17 -2.545 -6.856 -0.613 1.00 0.24 C ATOM 536 O4 DT A 17 -2.864 -6.591 0.531 1.00 0.33 O ATOM 537 C5 DT A 17 -3.288 -7.707 -1.503 1.00 0.20 C ATOM 538 C7 DT A 17 -4.629 -8.266 -1.036 1.00 0.22 C ATOM 539 C6 DT A 17 -2.835 -7.970 -2.748 1.00 0.20 C ATOM 0 H5' DT A 17 -2.823 -11.211 -4.346 1.00 0.26 H new ATOM 0 H5'' DT A 17 -1.294 -11.973 -3.955 1.00 0.26 H new ATOM 0 H4' DT A 17 -0.922 -10.568 -5.802 1.00 0.25 H new ATOM 0 H3' DT A 17 0.333 -9.750 -3.229 1.00 0.22 H new ATOM 0 H2' DT A 17 0.901 -7.528 -3.977 1.00 0.21 H new ATOM 0 H2'' DT A 17 0.688 -7.943 -5.666 1.00 0.21 H new ATOM 0 H1' DT A 17 -1.332 -6.798 -5.145 1.00 0.22 H new ATOM 0 H3 DT A 17 -0.824 -5.743 -0.548 1.00 0.24 H new ATOM 0 H71 DT A 17 -4.615 -8.389 0.047 1.00 0.22 H new ATOM 0 H72 DT A 17 -5.427 -7.577 -1.312 1.00 0.22 H new ATOM 0 H73 DT A 17 -4.805 -9.232 -1.509 1.00 0.22 H new ATOM 0 H6 DT A 17 -3.405 -8.623 -3.392 1.00 0.20 H new ATOM 552 P DT A 18 2.824 -9.771 -4.710 1.00 0.24 P ATOM 553 OP1 DT A 18 3.716 -10.639 -5.509 1.00 0.32 O ATOM 554 OP2 DT A 18 3.060 -9.589 -3.261 1.00 0.26 O ATOM 555 O5' DT A 18 2.741 -8.316 -5.412 1.00 0.23 O ATOM 556 C5' DT A 18 3.613 -7.236 -5.065 1.00 0.22 C ATOM 557 C4' DT A 18 5.032 -7.506 -5.590 1.00 0.23 C ATOM 558 O4' DT A 18 4.986 -8.593 -6.523 1.00 0.26 O ATOM 559 C3' DT A 18 5.686 -6.337 -6.303 1.00 0.28 C ATOM 560 O3' DT A 18 7.089 -6.364 -6.029 1.00 0.32 O ATOM 561 C2' DT A 18 5.423 -6.589 -7.783 1.00 0.36 C ATOM 562 C1' DT A 18 5.112 -8.096 -7.863 1.00 0.30 C ATOM 563 N1 DT A 18 3.858 -8.396 -8.617 1.00 0.31 N ATOM 564 C2 DT A 18 3.908 -8.234 -9.993 1.00 0.40 C ATOM 565 O2 DT A 18 4.940 -7.927 -10.585 1.00 0.45 O ATOM 566 N3 DT A 18 2.725 -8.434 -10.673 1.00 0.48 N ATOM 567 C4 DT A 18 1.509 -8.777 -10.116 1.00 0.45 C ATOM 568 O4 DT A 18 0.515 -8.903 -10.824 1.00 0.57 O ATOM 569 C5 DT A 18 1.540 -8.934 -8.680 1.00 0.33 C ATOM 570 C7 DT A 18 0.252 -9.278 -7.928 1.00 0.33 C ATOM 571 C6 DT A 18 2.680 -8.750 -7.987 1.00 0.29 C ATOM 0 H5' DT A 18 3.636 -7.112 -3.982 1.00 0.22 H new ATOM 0 H5'' DT A 18 3.234 -6.304 -5.485 1.00 0.22 H new ATOM 0 H4' DT A 18 5.629 -7.720 -4.703 1.00 0.23 H new ATOM 0 H3' DT A 18 5.302 -5.367 -5.988 1.00 0.28 H new ATOM 0 H2' DT A 18 4.587 -5.991 -8.146 1.00 0.36 H new ATOM 0 H2'' DT A 18 6.289 -6.329 -8.391 1.00 0.36 H new ATOM 0 H1' DT A 18 5.926 -8.579 -8.403 1.00 0.30 H new ATOM 0 H3 DT A 18 2.751 -8.317 -11.686 1.00 0.48 H new ATOM 0 H71 DT A 18 0.494 -9.858 -7.037 1.00 0.33 H new ATOM 0 H72 DT A 18 -0.255 -8.359 -7.636 1.00 0.33 H new ATOM 0 H73 DT A 18 -0.402 -9.863 -8.575 1.00 0.33 H new ATOM 0 H6 DT A 18 2.673 -8.882 -6.915 1.00 0.29 H new ATOM 584 P DG A 19 7.619 -6.122 -4.523 1.00 0.35 P ATOM 585 OP1 DG A 19 8.444 -7.289 -4.134 1.00 0.45 O ATOM 586 OP2 DG A 19 6.473 -5.719 -3.673 1.00 0.34 O ATOM 587 O5' DG A 19 8.603 -4.861 -4.696 1.00 0.35 O ATOM 588 C5' DG A 19 8.090 -3.528 -4.765 1.00 0.32 C ATOM 589 C4' DG A 19 7.401 -3.254 -6.099 1.00 0.21 C ATOM 590 O4' DG A 19 6.104 -3.845 -6.078 1.00 0.22 O ATOM 591 C3' DG A 19 7.236 -1.767 -6.417 1.00 0.19 C ATOM 592 O3' DG A 19 7.646 -1.486 -7.765 1.00 0.20 O ATOM 593 C2' DG A 19 5.756 -1.499 -6.283 1.00 0.17 C ATOM 594 C1' DG A 19 5.119 -2.876 -6.419 1.00 0.16 C ATOM 595 N9 DG A 19 3.978 -3.077 -5.519 1.00 0.15 N ATOM 596 C8 DG A 19 2.666 -3.330 -5.822 1.00 0.15 C ATOM 597 N7 DG A 19 1.886 -3.381 -4.779 1.00 0.16 N ATOM 598 C5 DG A 19 2.750 -3.153 -3.711 1.00 0.15 C ATOM 599 C6 DG A 19 2.485 -3.093 -2.322 1.00 0.16 C ATOM 600 O6 DG A 19 1.402 -3.203 -1.744 1.00 0.19 O ATOM 601 N1 DG A 19 3.642 -2.847 -1.599 1.00 0.16 N ATOM 602 C2 DG A 19 4.895 -2.672 -2.133 1.00 0.17 C ATOM 603 N2 DG A 19 5.876 -2.429 -1.271 1.00 0.17 N ATOM 604 N3 DG A 19 5.148 -2.726 -3.435 1.00 0.17 N ATOM 605 C4 DG A 19 4.031 -2.970 -4.159 1.00 0.16 C ATOM 0 H5' DG A 19 8.904 -2.817 -4.624 1.00 0.32 H new ATOM 0 H5'' DG A 19 7.383 -3.368 -3.951 1.00 0.32 H new ATOM 0 H4' DG A 19 8.042 -3.682 -6.870 1.00 0.21 H new ATOM 0 H3' DG A 19 7.842 -1.149 -5.755 1.00 0.19 H new ATOM 0 H2' DG A 19 5.518 -1.042 -5.322 1.00 0.17 H new ATOM 0 H2'' DG A 19 5.402 -0.817 -7.056 1.00 0.17 H new ATOM 0 H1' DG A 19 4.758 -2.970 -7.443 1.00 0.16 H new ATOM 0 H8 DG A 19 2.311 -3.474 -6.832 1.00 0.15 H new ATOM 0 H1 DG A 19 3.555 -2.791 -0.584 1.00 0.16 H new ATOM 0 H21 DG A 19 6.829 -2.290 -1.608 1.00 0.17 H new ATOM 0 H22 DG A 19 5.677 -2.381 -0.272 1.00 0.17 H new ATOM 617 P DG A 20 6.994 -2.237 -9.041 1.00 0.21 P ATOM 618 OP1 DG A 20 7.054 -3.696 -8.808 1.00 0.27 O ATOM 619 OP2 DG A 20 7.610 -1.668 -10.262 1.00 0.32 O ATOM 620 O5' DG A 20 5.441 -1.787 -9.009 1.00 0.20 O ATOM 621 C5' DG A 20 4.485 -2.452 -9.845 1.00 0.21 C ATOM 622 C4' DG A 20 3.085 -1.851 -9.740 1.00 0.20 C ATOM 623 O4' DG A 20 2.663 -1.793 -8.386 1.00 0.19 O ATOM 624 C3' DG A 20 2.982 -0.425 -10.275 1.00 0.23 C ATOM 625 O3' DG A 20 2.478 -0.440 -11.627 1.00 0.30 O ATOM 626 C2' DG A 20 1.984 0.270 -9.342 1.00 0.21 C ATOM 627 C1' DG A 20 1.628 -0.815 -8.311 1.00 0.18 C ATOM 628 N9 DG A 20 1.577 -0.358 -6.913 1.00 0.17 N ATOM 629 C8 DG A 20 2.603 0.037 -6.119 1.00 0.17 C ATOM 630 N7 DG A 20 2.299 0.191 -4.873 1.00 0.18 N ATOM 631 C5 DG A 20 0.957 -0.101 -4.835 1.00 0.16 C ATOM 632 C6 DG A 20 0.078 -0.095 -3.740 1.00 0.15 C ATOM 633 O6 DG A 20 0.348 0.144 -2.559 1.00 0.15 O ATOM 634 N1 DG A 20 -1.208 -0.440 -4.136 1.00 0.16 N ATOM 635 C2 DG A 20 -1.578 -0.748 -5.438 1.00 0.17 C ATOM 636 N2 DG A 20 -2.857 -0.995 -5.662 1.00 0.18 N ATOM 637 N3 DG A 20 -0.741 -0.762 -6.458 1.00 0.17 N ATOM 638 C4 DG A 20 0.501 -0.430 -6.086 1.00 0.16 C ATOM 0 H5' DG A 20 4.444 -3.507 -9.573 1.00 0.21 H new ATOM 0 H5'' DG A 20 4.819 -2.403 -10.881 1.00 0.21 H new ATOM 0 H4' DG A 20 2.461 -2.509 -10.345 1.00 0.20 H new ATOM 0 H3' DG A 20 3.946 0.083 -10.298 1.00 0.23 H new ATOM 0 H2' DG A 20 2.425 1.145 -8.865 1.00 0.21 H new ATOM 0 H2'' DG A 20 1.102 0.612 -9.883 1.00 0.21 H new ATOM 0 H1' DG A 20 0.628 -1.173 -8.557 1.00 0.18 H new ATOM 0 H8 DG A 20 3.599 0.210 -6.500 1.00 0.17 H new ATOM 0 H1 DG A 20 -1.932 -0.469 -3.419 1.00 0.16 H new ATOM 0 H21 DG A 20 -3.175 -1.226 -6.603 1.00 0.18 H new ATOM 0 H22 DG A 20 -3.526 -0.955 -4.893 1.00 0.18 H new ATOM 650 P DG A 21 1.107 -1.198 -12.040 1.00 0.35 P ATOM 651 OP1 DG A 21 0.336 -1.506 -10.814 1.00 0.44 O ATOM 652 OP2 DG A 21 1.453 -2.286 -12.982 1.00 0.48 O ATOM 653 O5' DG A 21 0.311 -0.062 -12.865 1.00 0.36 O ATOM 654 C5' DG A 21 0.565 1.333 -12.643 1.00 0.34 C ATOM 655 C4' DG A 21 -0.641 2.036 -12.024 1.00 0.28 C ATOM 656 O4' DG A 21 -0.859 1.562 -10.698 1.00 0.24 O ATOM 657 C3' DG A 21 -0.489 3.543 -11.898 1.00 0.30 C ATOM 658 O3' DG A 21 -0.815 4.215 -13.119 1.00 0.37 O ATOM 659 C2' DG A 21 -1.482 3.877 -10.795 1.00 0.29 C ATOM 660 C1' DG A 21 -1.516 2.597 -9.954 1.00 0.24 C ATOM 661 N9 DG A 21 -0.838 2.716 -8.651 1.00 0.20 N ATOM 662 C8 DG A 21 0.496 2.881 -8.383 1.00 0.19 C ATOM 663 N7 DG A 21 0.776 2.936 -7.114 1.00 0.17 N ATOM 664 C5 DG A 21 -0.460 2.805 -6.497 1.00 0.16 C ATOM 665 C6 DG A 21 -0.791 2.798 -5.124 1.00 0.15 C ATOM 666 O6 DG A 21 -0.054 2.908 -4.168 1.00 0.17 O ATOM 667 N1 DG A 21 -2.140 2.647 -4.925 1.00 0.15 N ATOM 668 C2 DG A 21 -3.078 2.524 -5.921 1.00 0.17 C ATOM 669 N2 DG A 21 -4.346 2.434 -5.540 1.00 0.21 N ATOM 670 N3 DG A 21 -2.777 2.524 -7.216 1.00 0.20 N ATOM 671 C4 DG A 21 -1.451 2.671 -7.429 1.00 0.18 C ATOM 0 H5' DG A 21 0.819 1.811 -13.589 1.00 0.34 H new ATOM 0 H5'' DG A 21 1.428 1.446 -11.987 1.00 0.34 H new ATOM 0 H4' DG A 21 -1.464 1.814 -12.703 1.00 0.28 H new ATOM 0 H3' DG A 21 0.531 3.858 -11.679 1.00 0.30 H new ATOM 0 H2' DG A 21 -1.157 4.736 -10.208 1.00 0.29 H new ATOM 0 H2'' DG A 21 -2.465 4.120 -11.198 1.00 0.29 H new ATOM 0 HO3' DG A 21 -0.707 5.182 -12.999 1.00 0.37 H new ATOM 0 H1' DG A 21 -2.564 2.380 -9.749 1.00 0.24 H new ATOM 0 H8 DG A 21 1.247 2.958 -9.156 1.00 0.19 H new ATOM 0 H1 DG A 21 -2.473 2.624 -3.961 1.00 0.15 H new ATOM 0 H21 DG A 21 -5.083 2.341 -6.239 1.00 0.21 H new ATOM 0 H22 DG A 21 -4.583 2.458 -4.548 1.00 0.21 H new TER 684 DG A 21